N-{[5-(4-ethylpiperazin-1-yl)-3-methyl-1-phenyl-1H-pyrazol-4-yl]methyl}-3-nitro-N-propylbenzamide
Chemical Structure Depiction of
N-{[5-(4-ethylpiperazin-1-yl)-3-methyl-1-phenyl-1H-pyrazol-4-yl]methyl}-3-nitro-N-propylbenzamide
N-{[5-(4-ethylpiperazin-1-yl)-3-methyl-1-phenyl-1H-pyrazol-4-yl]methyl}-3-nitro-N-propylbenzamide
Compound characteristics
| Compound ID: | V015-4640 |
| Compound Name: | N-{[5-(4-ethylpiperazin-1-yl)-3-methyl-1-phenyl-1H-pyrazol-4-yl]methyl}-3-nitro-N-propylbenzamide |
| Molecular Weight: | 490.61 |
| Molecular Formula: | C27 H34 N6 O3 |
| Salt: | not_available |
| Smiles: | CCCN(Cc1c(C)nn(c2ccccc2)c1N1CCN(CC)CC1)C(c1cccc(c1)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0845 |
| logD: | 2.0158 |
| logSw: | -4.1273 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 70.022 |
| InChI Key: | IVMZDDOUIVNWRN-UHFFFAOYSA-N |